1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxy-quinolin-2-one

Systemtic Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxy-quinolin-2-one Openeye Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxy-quinolin-2-one CAS Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxy-2-quinolinone IUPAC Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxyquinolin-2-one Traditional Name: 1-butyl-7-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-4-hexoxy-3-octoxy-carbostyril Formula: C37H60N2O3 MolecularWeight: 580.8839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C(C=C2)NCC=C(C)CCC=C(C)C)N(C1=O)CCCC)OCCCCCC

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C(C=C2)NC/C=C(\C)/CCC=C(C)C)N(C1=O)CCCC)OCCCCCC

InChI

InChI=1S/C37H60N2O3/c1-7-10-13-15-16-18-28-42-36-35(41-27-17-14-11-8-2)33-23-22-32(29-34(33)39(37(36)40)26-12-9-3)38-25-24-31(6)21-19-20-30(4)5/h20,22-24,29,38H,7-19,21,25-28H2,1-6H3/b31-24+